4-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: 4-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: 4-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: 4-[oxo-(2-pyrimidinylhydrazo)methyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: 4-[(pyrimidin-2-ylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: 4-[(2-pyrimidylamino)carbamoyl]-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C18H14F3N5O3S MolecularWeight: 437.39567

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NNC3=NC=CC=N3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)NNC3=NC=CC=N3)C(F)(F)F

InChI

InChI=1S/C18H14F3N5O3S/c19-18(20,21)13-3-1-4-14(11-13)26-30(28,29)15-7-5-12(6-8-15)16(27)24-25-17-22-9-2-10-23-17/h1-11,26H,(H,24,27)(H,22,23,25)